1H-indeno[1,2-b]pyridine-2,5-dione

C12H7NO2 — CID 45098873

IUPAC1H-indeno[1,2-b]pyridine-2,5-dione
SMILESO=C1c2ccccc2-c2[nH]c(=O)ccc21
InChIInChI=1S/C12H7NO2/c14-10-6-5-9-11(13-10)7-3-1-2-4-8(7)12(9)15/h1-6H,(H,13,14)
InChIKeyWZMBZJVPPGWAPI-UHFFFAOYSA-N
MW197.19 g/mol
LogP1.59
Rot. Bonds

About 1H-indeno[1,2-b]pyridine-2,5-dione

1H-indeno[1,2-b]pyridine-2,5-dione (PubChem CID 45098873) has the molecular formula C12H7NO2 and a molecular weight of 197.19 g/mol. Its IUPAC name is 1H-indeno[1,2-b]pyridine-2,5-dione.

Molecular Properties

Compound Name1H-indeno[1,2-b]pyridine-2,5-dione
PubChem CID45098873
Molecular FormulaC12H7NO2
Molecular Weight197.19 g/mol
Exact Mass197.05
IUPAC Name1H-indeno[1,2-b]pyridine-2,5-dione
SMILESO=C1c2ccccc2-c2[nH]c(=O)ccc21
InChIInChI=1S/C12H7NO2/c14-10-6-5-9-11(13-10)7-3-1-2-4-8(7)12(9)15/h1-6H,(H,13,14)
InChIKeyWZMBZJVPPGWAPI-UHFFFAOYSA-N
XLogP1.59
TPSA49.93 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.19
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'keto_phenone_A(11)', 'substructure': 'N/A'}

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Related Compounds

anthracene-9,10-dione;hydrofluoride
CID 172728823
CID 67824005
CID 67824005
CID 66807709
CID 66807709
lithium;anthracene-9,10-dione;hydride
CID 174683199
4H-indeno[1,2-b]pyrazine-3,9-dione
CID 19035976
1,4-dihydrobenzo[g]quinoxaline-2,3,5,10-tetrone
CID 121014847
anthracene-9,10-dione;platinum(2+);dichloride
CID 174702138
anthracene-9,10-dione;hydrate;hydrochloride
CID 177309925
4-(hydroxymethyl)-1H-indeno[2,1-b]pyridine-2,9-dione
CID 162846113
CID 158261979
CID 158261979
sodium;fluoren-9-one;hydride
CID 174594472
anthracene-9,10-dione;carbamic acid
CID 70556478

Frequently Asked Questions

What is the IUPAC name of 1H-indeno[1,2-b]pyridine-2,5-dione?
The IUPAC name of 1H-indeno[1,2-b]pyridine-2,5-dione (CID 45098873) is 1H-indeno[1,2-b]pyridine-2,5-dione.
What is the SMILES notation for 1H-indeno[1,2-b]pyridine-2,5-dione?
The canonical SMILES for 1H-indeno[1,2-b]pyridine-2,5-dione is O=C1c2ccccc2-c2[nH]c(=O)ccc21.
What is the InChIKey of 1H-indeno[1,2-b]pyridine-2,5-dione?
The InChIKey is WZMBZJVPPGWAPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7NO2/c14-10-6-5-9-11(13-10)7-3-1-2-4-8(7)12(9)15/h1-6H,(H,13,14).
What are the key properties of 1H-indeno[1,2-b]pyridine-2,5-dione?
1H-indeno[1,2-b]pyridine-2,5-dione has a molecular weight of 197.19 g/mol, XLogP of 1.59, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-indeno[1,2-b]pyridine-2,5-dione is sourced from PubChem (CID 45098873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).